Crystallography Open Database

Information card for entry 4134687

Preview

Coordinates	4134687.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C265 H296 Mg24 N2 O129
Calculated formula	C265 H261 Mg24 N2 O129
Title of publication	Construction of Polymeric Metal-Organic Nanocapsule Networks via Supramolecular Coordination-Driven Self-Assembly.
Authors of publication	Shao, Li; Hua, Bin; Hu, Xiangquan; Stalla, David; Kelley, Steven P.; Atwood, Jerry L.
Journal of publication	Journal of the American Chemical Society
Year of publication	2020
Journal volume	142
Journal issue	16
Pages of publication	7270 - 7275
a	37.025 ± 0.005 Å
b	36.916 ± 0.005 Å
c	26.53 ± 0.004 Å
α	90°
β	94.801 ± 0.004°
γ	90°
Cell volume	36134 ± 9 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1382
Residual factor for significantly intense reflections	0.089
Weighted residual factors for significantly intense reflections	0.2539
Weighted residual factors for all reflections included in the refinement	0.2987
Goodness-of-fit parameter for all reflections included in the refinement	1.027
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
251458 (current)	2020-05-04	cif/ Updating files of 4134686, 4134687 Original log message: Adding full bibliography for 4134686--4134687.cif.	4134687.cif
250717	2020-04-14	cif/ Adding structures of 4134687 via cif-deposit CGI script.	4134687.cif